6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenyl]methyl]-1H-imidazo[1,2-a]pyridin-4-ium-3-carboxamide
CAS: -
| 1 | HUU |
No description available for this item
| Molecular Formula | C29H29ClF3N4O2+ |
|---|---|
| Canonical SMILES | |
| Isomeric SMILES | |
| Molecular Weight | 558.0000 |
| InChIKey | OJICYBSWSZGRFB-UHFFFAOYSA-O |
| InChI | InChI=1S/C29H28ClF3N4O2/c1-2-25-27(37-18-22(30)7-12-26(37)35-25)28(38)34-17-19-3-8-23(9-4-19)36-15-13-21(14-16-36)20-5-10-24(11-6-20)39-29(31,32)33/h3-12,18,21H,2,13-17H2,1H3,(H,34,38)/p+1 |
| XLogP | 8.0000 |
| ExactMass | 557.1931 |
| MonoisotopicMass | 557.1931 |
| TPSA | 61.5000 |
| Complexity | 796.0000 |
| Charge | 1.0000 |
| HBondDonorCount | 2 |
| HBondAcceptorCount | 6 |
| RotatableBondCount | 7 |
| HeavyAtomCount | 39 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 0 |
| PatentFamilyCount | 0 |
| LiteratureCount | 0 |